6-[3-[5-bromanyl-2-(trifluoromethyl)phenyl]-4-fluoranyl-phenyl]-4-methyl-5-oxidanylidene-pyrazine-2-carboxamide

Systemtic Name: 6-[3-[5-bromanyl-2-(trifluoromethyl)phenyl]-4-fluoranyl-phenyl]-4-methyl-5-oxidanylidene-pyrazine-2-carboxamide Openeye Name: 6-[3-[5-bromo-2-(trifluoromethyl)phenyl]-4-fluoro-phenyl]-4-methyl-5-oxo-pyrazine-2-carboxamide CAS Name: 6-[3-[5-bromo-2-(trifluoromethyl)phenyl]-4-fluorophenyl]-4-methyl-5-oxo-2-pyrazinecarboxamide IUPAC Name: 6-[3-[5-bromo-2-(trifluoromethyl)phenyl]-4-fluorophenyl]-4-methyl-5-oxopyrazine-2-carboxamide Traditional Name: 6-[3-[5-bromo-2-(trifluoromethyl)phenyl]-4-fluoro-phenyl]-5-keto-4-methyl-pyrazinamide Formula: C19H12BrF4N3O2 MolecularWeight: 470.215093

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C(C1=O)C2=CC(=C(C=C2)F)C3=C(C=CC(=C3)Br)C(F)(F)F)C(=O)N

Isomeric SMILES

CN1C=C(N=C(C1=O)C2=CC(=C(C=C2)F)C3=C(C=CC(=C3)Br)C(F)(F)F)C(=O)N

InChI

InChI=1S/C19H12BrF4N3O2/c1-27-8-15(17(25)28)26-16(18(27)29)9-2-5-14(21)12(6-9)11-7-10(20)3-4-13(11)19(22,23)24/h2-8H,1H3,(H2,25,28)